2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(E)-3-methoxy-3-oxo-prop-1-enyl]benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-5-[(E)-3-methoxy-3-oxoprop-1-enyl]benzoate IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-[(E)-3-methoxy-3-oxoprop-1-enyl]benzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]-5-[(E)-3-keto-3-methoxy-prop-1-enyl]benzoate Formula: C25H20N3O5- MolecularWeight: 442.4434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)[O-]

Isomeric SMILES

COC(=O)/C=C/C1=CC(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)[O-]

InChI

InChI=1S/C25H21N3O5/c1-33-22(29)13-7-15-6-12-19(21(14-15)25(31)32)18-4-2-3-5-20(18)24(30)28-17-10-8-16(9-11-17)23(26)27/h2-14H,1H3,(H3,26,27)(H,28,30)(H,31,32)/p-1/b13-7+